PDB ligand accession: 1XC
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ZYTGSQWLYZVDKX-IGGXFAESSA-O
SMILES: c1cc(ccc1CNC(=O)c2ccc3n(c2)cc[n+]3C4C(C(C(O4)COP(=O)(O)O)O)O)S(=O)(=O)c5cc(cc(c5)F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbohydrates and carbohydrate conjugates
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4O16 | Download | Experimental | e4o16A2 | TIM beta/alpha-barrel | LigPlot |
4L4L | Download | Experimental | e4l4lA3 e4l4lB2 e4l4lA2 e4l4lA3 e4l4lB3 | TIM beta/alpha-barrel alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |